CID 115384484

Methyl imidazo[2,1-b][1,3]thiazole-2-carboxylate

Structural Information

Molecular Formula
C7H6N2O2S
SMILES
COC(=O)C1=CN2C=CN=C2S1
InChI
InChI=1S/C7H6N2O2S/c1-11-6(10)5-4-9-3-2-8-7(9)12-5/h2-4H,1H3
InChIKey
CTUTYJPDHWNMRT-UHFFFAOYSA-N
Compound name
methyl imidazo[2,1-b][1,3]thiazole-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.015 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.02228 135.2
[M+Na]+ 205.00422 147.5
[M-H]- 181.00772 139.0
[M+NH4]+ 200.04882 158.3
[M+K]+ 220.97816 146.1
[M+H-H2O]+ 165.01226 129.8
[M+HCOO]- 227.01320 155.5
[M+CH3COO]- 241.02885 150.3
[M+Na-2H]- 202.98967 138.2
[M]+ 182.01445 141.8
[M]- 182.01555 141.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe